O6-methyl O1-(phenylmethyl) (2S)-4-oxidanylidene-2-(phenylmethoxycarbonylamino)hexanedioate

Systemtic Name: O6-methyl O1-(phenylmethyl) (2S)-4-oxidanylidene-2-(phenylmethoxycarbonylamino)hexanedioate Openeye Name: O1-benzyl O6-methyl (2S)-2-(benzyloxycarbonylamino)-4-oxo-hexanedioate CAS Name: (2S)-4-oxo-2-(phenylmethoxycarbonylamino)hexanedioic acid O6-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 6-O-methyl (2S)-4-oxo-2-(phenylmethoxycarbonylamino)hexanedioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-keto-adipic acid O1-benzyl ester O6-methyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CC(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(=O)C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H23NO7/c1-28-20(25)13-18(24)12-19(21(26)29-14-16-8-4-2-5-9-16)23-22(27)30-15-17-10-6-3-7-11-17/h2-11,19H,12-15H2,1H3,(H,23,27)/t19-/m0/s1